Time-dependent density functional theory study of the optical properties of tetrahedral aluminum nanoparticles. - Gyun-Tack Bae; Christine M. Aikens (J. Comput. Chem., 2022)

Gaussian Process Approach to Constructing Transferable Force Fields for Thiolate-Protected Gold Nanoclusters. - Yuchen Wang; D. Sulalith N. D. Samarasinghe; Hao Deng; Bin Liu; Christine M. Aikens (J. Chem. Inf. Model., 2025)